Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4a8e_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 5.A N ASP 2.A O no hydrogen 2.889 N/A GLU 7.A N ASP 3.A O no hydrogen 3.171 N/A PHE 8.A N THR 4.A O no hydrogen 2.711 N/A ALA 9.A N ILE 5.A O no hydrogen 2.927 N/A THR 10.A N GLU 6.A O no hydrogen 3.423 N/A THR 10.A OG1 GLU 7.A O no hydrogen 2.963 N/A TYR 11.A N GLU 7.A O no hydrogen 2.921 N/A LEU 12.A N PHE 8.A O no hydrogen 3.147 N/A GLU 13.A N ALA 9.A O no hydrogen 2.922 N/A LEU 14.A N THR 10.A O no hydrogen 2.826 N/A GLU 15.A N TYR 11.A O no hydrogen 3.005 N/A GLY 16.A N GLU 13.A O no hydrogen 2.903 N/A LYS 17.A N LEU 12.A O no hydrogen 2.901 N/A SER 18.A OG THR 21.A OG1 no hydrogen 3.420 N/A ASN 20.A N SER 18.A OG no hydrogen 3.360 N/A THR 21.A OG1 SER 18.A O no hydrogen 3.369 N/A VAL 22.A N SER 18.A O no hydrogen 2.901 N/A ARG 23.A N ARG 19.A O no hydrogen 3.137 N/A ARG 23.A NE ASN 20.A OD1 no hydrogen 2.756 N/A ARG 23.A NH2 ASN 20.A OD1 no hydrogen 2.762 N/A MET 24.A N ASN 20.A O no hydrogen 2.879 N/A TYR 25.A N THR 21.A O no hydrogen 2.693 N/A THR 26.A N VAL 22.A O no hydrogen 3.051 N/A THR 26.A OG1 VAL 22.A O no hydrogen 3.174 N/A TYR 27.A N ARG 23.A O no hydrogen 2.912 N/A TYR 28.A N MET 24.A O no hydrogen 2.988 N/A ILE 29.A N TYR 25.A O no hydrogen 2.842 N/A SER 30.A N THR 26.A O no hydrogen 3.043 N/A SER 30.A OG THR 26.A O no hydrogen 2.871 N/A LYS 31.A N TYR 27.A O no hydrogen 3.187 N/A PHE 32.A N TYR 28.A O no hydrogen 2.812 N/A PHE 33.A N ILE 29.A O no hydrogen 3.183 N/A GLU 34.A N SER 30.A O no hydrogen 2.856 N/A GLU 35.A N LYS 31.A O no hydrogen 3.047 N/A SER 38.A N ASP 43.A OD2 no hydrogen 2.973 N/A THR 40.A N SER 38.A O no hydrogen 2.625 N/A THR 40.A OG1 SER 38.A O no hydrogen 3.380 N/A ASP 43.A N THR 40.A OG1 no hydrogen 3.274 N/A ALA 44.A N THR 40.A O no hydrogen 3.383 N/A LEU 45.A N ALA 41.A O no hydrogen 3.526 N/A ARG 46.A N ARG 42.A O no hydrogen 2.957 N/A PHE 47.A N ASP 43.A O no hydrogen 2.934 N/A PHE 47.A N ALA 44.A O no hydrogen 2.963 N/A LEU 48.A N ALA 44.A O no hydrogen 2.709 N/A ALA 49.A N LEU 45.A O no hydrogen 3.051 N/A LYS 50.A NZ ARG 46.A O no hydrogen 3.331 N/A LEU 51.A N PHE 47.A O no hydrogen 3.350 N/A LYS 52.A N LEU 48.A O no hydrogen 2.929 N/A ARG 53.A N ALA 49.A O no hydrogen 2.963 N/A LYS 54.A N LYS 50.A O no hydrogen 2.907 N/A GLY 55.A N LYS 52.A O no hydrogen 2.922 N/A LEU 61.A N SER 57.A O no hydrogen 2.884 N/A ASN 62.A N THR 58.A O no hydrogen 2.670 N/A LEU 63.A N ARG 59.A O no hydrogen 3.077 N/A VAL 64.A N SER 60.A O no hydrogen 3.147 N/A ILE 65.A N LEU 61.A O no hydrogen 2.900 N/A GLN 66.A N ASN 62.A O no hydrogen 3.118 N/A ALA 67.A N LEU 63.A O no hydrogen 2.829 N/A LEU 68.A N VAL 64.A O no hydrogen 2.989 N/A LYS 69.A N ILE 65.A O no hydrogen 2.968 N/A LYS 69.A NZ LEU 84.A O no hydrogen 2.637 N/A ALA 70.A N GLN 66.A O no hydrogen 2.962 N/A TYR 71.A N ALA 67.A O no hydrogen 3.120 N/A PHE 72.A N LEU 68.A O no hydrogen 2.881 N/A LYS 73.A N LYS 69.A O no hydrogen 3.130 N/A PHE 74.A N ALA 70.A O no hydrogen 3.280 N/A GLU 75.A N TYR 71.A O no hydrogen 2.791 N/A GLY 76.A N PHE 72.A O no hydrogen 2.763 N/A GLY 76.A N LYS 73.A O no hydrogen 3.193 N/A ASP 78.A N GLY 76.A O no hydrogen 2.643 N/A LYS 85.A N LYS 83.A O no hydrogen 3.032 N/A LYS 85.A NZ THR 86.A O no hydrogen 3.545 N/A SER 96.A OG LEU 97.A O no hydrogen 3.375 N/A SER 96.A OG THR 226.A OG1 no hydrogen 3.122 N/A THR 98.A N GLU 101.A OE1 no hydrogen 2.683 N/A THR 98.A OG1 GLU 101.A OE1 no hydrogen 2.909 N/A GLU 101.A N THR 98.A OG1 no hydrogen 3.168 N/A VAL 102.A N THR 98.A O no hydrogen 2.949 N/A ARG 103.A N GLU 99.A O no hydrogen 2.814 N/A ARG 103.A NH2 GLU 99.A OE1 no hydrogen 3.407 N/A ARG 103.A NH2 LYS 264.A O no hydrogen 3.051 N/A ARG 104.A N GLU 100.A O no hydrogen 2.998 N/A ARG 104.A NE ALA 211.A O no hydrogen 3.108 N/A ARG 104.A NH2 ALA 211.A O no hydrogen 3.124 N/A ILE 105.A N GLU 101.A O no hydrogen 3.037 N/A ILE 105.A N VAL 102.A O no hydrogen 3.020 N/A ILE 106.A N VAL 102.A O no hydrogen 2.877 N/A ASN 107.A N ARG 103.A O no hydrogen 2.971 N/A ALA 108.A N ARG 104.A O no hydrogen 3.209 N/A ALA 108.A N ILE 105.A O no hydrogen 3.200 N/A ALA 109.A N ILE 106.A O no hydrogen 3.068 N/A GLU 110.A N TYR 207.A OH no hydrogen 3.246 N/A ARG 113.A NH1 VAL 185.A O no hydrogen 2.695 N/A ARG 113.A NH2 ASP 114.A OD1 no hydrogen 3.213 N/A ASP 114.A N THR 111.A OG1 no hydrogen 3.206 N/A ARG 115.A N THR 111.A O no hydrogen 2.948 N/A ARG 115.A NE GLU 168.A OE1 no hydrogen 3.020 N/A ARG 115.A NH2 GLU 168.A OE2 no hydrogen 2.769 N/A LEU 116.A N LEU 112.A O no hydrogen 2.751 N/A ILE 117.A N ARG 113.A O no hydrogen 3.029 N/A LEU 118.A N ASP 114.A O no hydrogen 3.131 N/A LEU 119.A N ARG 115.A O no hydrogen 2.789 N/A LEU 120.A N LEU 116.A O no hydrogen 2.820 N/A LEU 121.A N ILE 117.A O no hydrogen 2.831 N/A TYR 122.A N LEU 118.A O no hydrogen 3.071 N/A TYR 122.A OH HIS 227.A ND1 no hydrogen 3.171 N/A GLY 123.A N LEU 119.A O no hydrogen 2.701 N/A ALA 124.A N LEU 120.A O no hydrogen 2.677 N/A ARG 127.A N GLU 130.A OE1 no hydrogen 2.850 N/A LEU 131.A N ARG 127.A O no hydrogen 3.068 N/A CYS 132.A N VAL 128.A O no hydrogen 2.785 N/A CYS 132.A SG VAL 128.A O no hydrogen 3.206 N/A CYS 132.A SG LEU 195.A O no hydrogen 3.418 N/A CYS 132.A SG SER 196.A O no hydrogen 3.061 N/A ASN 133.A N SER 129.A O no hydrogen 2.725 N/A LEU 134.A N GLU 130.A O no hydrogen 2.814 N/A LEU 134.A N LEU 131.A O no hydrogen 3.188 N/A ARG 135.A NH1 GLU 137.A OE2 no hydrogen 2.877 N/A VAL 136.A N PRO 181.A O no hydrogen 2.915 N/A ASP 138.A N ARG 135.A O no hydrogen 2.812 N/A VAL 139.A N VAL 136.A O no hydrogen 2.934 N/A ASN 140.A N VAL 145.A O no hydrogen 3.019 N/A TYR 143.A N ASN 140.A OD1 no hydrogen 2.963 N/A GLY 144.A N ASN 140.A O no hydrogen 3.013 N/A VAL 145.A N ASN 140.A O no hydrogen 3.378 N/A ILE 146.A N VAL 159.A O no hydrogen 2.892 N/A VAL 147.A N ASP 138.A O no hydrogen 3.133 N/A VAL 148.A N ARG 157.A O no hydrogen 2.573 N/A ARG 149.A NE ASP 138.A OD1 no hydrogen 2.944 N/A ARG 149.A NH2 ASP 138.A OD1 no hydrogen 2.736 N/A GLY 150.A N ASP 156.A OD1 no hydrogen 2.528 N/A ARG 157.A N VAL 148.A O no hydrogen 3.010 N/A ARG 157.A NE LEU 241.A O no hydrogen 2.636 N/A ARG 157.A NH1 GLU 130.A OE2 no hydrogen 2.670 N/A ARG 157.A NH2 GLU 130.A OE1 no hydrogen 2.814 N/A ARG 157.A NH2 GLU 130.A OE2 no hydrogen 3.032 N/A VAL 159.A N ILE 146.A O no hydrogen 2.736 N/A ILE 161.A N GLY 144.A O no hydrogen 3.071 N/A LEU 165.A N SER 162.A OG no hydrogen 3.248 N/A LEU 166.A N SER 162.A O no hydrogen 2.939 N/A SER 167.A N GLU 163.A O no hydrogen 2.609 N/A SER 167.A OG GLU 163.A O no hydrogen 3.094 N/A GLU 168.A N SER 164.A O no hydrogen 3.200 N/A ILE 169.A N LEU 165.A O no hydrogen 3.048 N/A LYS 170.A N LEU 166.A O no hydrogen 3.214 N/A ARG 171.A N SER 167.A O no hydrogen 2.972 N/A TYR 172.A N GLU 168.A O no hydrogen 2.816 N/A TYR 172.A OH LEU 183.A O no hydrogen 2.823 N/A LEU 173.A N ILE 169.A O no hydrogen 2.629 N/A GLU 174.A N LYS 170.A O no hydrogen 2.824 N/A SER 175.A N TYR 172.A O no hydrogen 2.963 N/A SER 175.A OG TYR 172.A O no hydrogen 2.463 N/A ARG 176.A N LEU 173.A O no hydrogen 3.069 N/A ARG 176.A NE ASP 178.A OD1 no hydrogen 2.948 N/A ARG 176.A NE ASP 178.A OD2 no hydrogen 2.885 N/A ARG 176.A NH1 TYR 182.A O no hydrogen 2.988 N/A ARG 176.A NH2 ASP 178.A OD1 no hydrogen 2.803 N/A ARG 176.A NH2 TYR 182.A O no hydrogen 2.975 N/A SER 180.A N ASP 178.A OD1 no hydrogen 3.364 N/A TYR 182.A N SER 180.A OG no hydrogen 3.340 N/A LEU 183.A N LEU 134.A O no hydrogen 3.215 N/A GLU 186.A N ASP 193.A O no hydrogen 2.980 N/A LYS 188.A NZ LYS 190.A O no hydrogen 3.111 N/A LYS 194.A N ASP 193.A OD1 no hydrogen 2.571 N/A LYS 194.A NZ ASN 133.A OD1 no hydrogen 2.799 N/A LYS 194.A NZ TYR 182.A OH no hydrogen 3.311 N/A SER 196.A OG THR 199.A OG1 no hydrogen 2.465 N/A THR 199.A N SER 196.A OG no hydrogen 2.888 N/A THR 199.A OG1 GLU 186.A OE1 no hydrogen 3.123 N/A THR 199.A OG1 GLU 186.A OE2 no hydrogen 3.434 N/A THR 199.A OG1 SER 196.A OG no hydrogen 2.465 N/A TRP 201.A N PRO 197.A O no hydrogen 2.857 N/A ARG 202.A N LYS 198.A O no hydrogen 2.722 N/A LEU 203.A N THR 199.A O no hydrogen 2.958 N/A VAL 204.A N VAL 200.A O no hydrogen 2.929 N/A VAL 204.A N TRP 201.A O no hydrogen 3.221 N/A LYS 205.A N TRP 201.A O no hydrogen 3.174 N/A LYS 205.A NZ GLU 214.A OE2 no hydrogen 2.881 N/A LYS 206.A N ARG 202.A O no hydrogen 3.079 N/A LYS 206.A NZ GLU 110.A OE2 no hydrogen 3.276 N/A TYR 207.A N LEU 203.A O no hydrogen 3.478 N/A TYR 207.A OH ASP 114.A OD2 no hydrogen 2.456 N/A GLY 208.A N VAL 204.A O no hydrogen 2.888 N/A ARG 209.A N LYS 205.A O no hydrogen 2.813 N/A LYS 210.A N LYS 206.A O no hydrogen 3.138 N/A ALA 211.A N TYR 207.A O no hydrogen 2.974 N/A GLY 212.A N ARG 209.A O no hydrogen 2.556 N/A VAL 213.A N GLY 208.A O no hydrogen 2.723 N/A GLN 219.A N THR 216.A O no hydrogen 2.708 N/A GLN 219.A NE2 GLU 214.A O no hydrogen 3.497 N/A LEU 220.A N PRO 217.A O no hydrogen 3.018 N/A ARG 221.A N PRO 217.A O no hydrogen 3.270 N/A ARG 221.A NH1 GLY 125.A O no hydrogen 2.656 N/A ARG 221.A NH2 LEU 242.A O no hydrogen 2.777 N/A HIS 222.A N HIS 218.A O no hydrogen 2.768 N/A SER 223.A N GLN 219.A O no hydrogen 2.985 N/A SER 223.A OG GLN 219.A O no hydrogen 2.596 N/A PHE 224.A N LEU 220.A O no hydrogen 2.972 N/A ALA 225.A N ARG 221.A O no hydrogen 3.174 N/A THR 226.A N HIS 222.A O no hydrogen 2.830 N/A THR 226.A OG1 SER 96.A OG no hydrogen 3.122 N/A THR 226.A OG1 HIS 222.A O no hydrogen 3.524 N/A HIS 227.A N SER 223.A O no hydrogen 2.811 N/A MET 228.A N PHE 224.A O no hydrogen 2.906 N/A LEU 229.A N ALA 225.A O no hydrogen 3.172 N/A GLU 230.A N THR 226.A O no hydrogen 2.687 N/A ARG 231.A N HIS 227.A O no hydrogen 2.985 N/A ARG 231.A NH1 ALA 259.A O no hydrogen 2.389 N/A ARG 231.A NH1 VAL 260.A O no hydrogen 3.519 N/A ARG 231.A NH2 GLU 99.A OE2 no hydrogen 2.441 N/A GLY 232.A N LEU 229.A O no hydrogen 2.786 N/A ILE 233.A N MET 228.A O no hydrogen 3.364 N/A ARG 236.A N ASP 234.A OD2 no hydrogen 2.892 N/A ILE 238.A N ASP 234.A O no hydrogen 3.441 N/A GLN 239.A N ILE 235.A O no hydrogen 2.833 N/A GLN 239.A NE2 GLN 239.A O no hydrogen 2.532 N/A GLN 239.A NE2 HIS 244.A ND1 no hydrogen 3.245 N/A GLU 240.A N ARG 236.A O no hydrogen 2.695 N/A LEU 241.A N ILE 237.A O no hydrogen 2.683 N/A LEU 242.A N ILE 238.A O no hydrogen 2.966 N/A GLY 243.A N GLN 239.A O no hydrogen 3.190 N/A GLY 243.A N GLU 240.A O no hydrogen 2.947 N/A HIS 244.A N LEU 242.A O no hydrogen 3.012 N/A THR 253.A N THR 249.A O no hydrogen 3.199 N/A THR 253.A OG1 THR 249.A O no hydrogen 3.280 N/A HIS 255.A N VAL 251.A O no hydrogen 2.695 N/A LEU 256.A N SER 252.A O no hydrogen 2.811 N/A LYS 257.A N THR 253.A O no hydrogen 3.283 N/A GLU 258.A N LYS 254.A O no hydrogen 3.286 N/A ALA 259.A N HIS 255.A O no hydrogen 3.129 N/A VAL 260.A N LYS 257.A O no hydrogen 3.156 N/A LYS 262.A NZ SER 164.A OG no hydrogen 2.804 N/A LYS 264.A N VAL 260.A O no hydrogen 3.055 N/A LYS 264.A N LYS 261.A O no hydrogen 3.283 N/A LEU 265.A N LYS 262.A O no hydrogen 2.912 N/A VAL 266.A N LYS 262.A O no hydrogen 3.030 N/A